trisodium; 4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol; phenol; phosphate

Systemtic Name: trisodium; 4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol; phenol; phosphate Openeye Name: trisodium; 4-[(E)-1-ethyl-2-(4-hydroxyphenyl)but-1-enyl]phenol; phenol; phosphate CAS Name: trisodium; 4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol; phenol; phosphate IUPAC Name: trisodium; 4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol; phenol; phosphate Traditional Name: trisodium; 4-[(E)-1-ethyl-2-(4-hydroxyphenyl)but-1-enyl]phenol; phenol; phosphate Formula: C24H26Na3O7P MolecularWeight: 526.402111

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(CC)C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1=CC=C(C=C1)O.[O-]P(=O)([O-])[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

CC/C(=C(/CC)\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)O.C1=CC=C(C=C1)O.[O-]P(=O)([O-])[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C18H20O2.C6H6O.3Na.H3O4P/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14;7-6-4-2-1-3-5-6;;;;1-5(2,3)4/h5-12,19-20H,3-4H2,1-2H3;1-5,7H;;;;(H3,1,2,3,4)/q;;3*+1;/p-3/b18-17+;;;;;